MolecularTopologyAtomIndices Struct Reference

#include <gromacs/domdec/reversetopology.h>

Description

Molecular topology indices of a global molecule a global atom belongs to.

Public Attributes
int	blockIndex
	The index of the molecule block.
int	moleculeType
	The molecule type.
int	moleculeIndex
	The index of the molecule in the block.
int	atomIndex
	The index of the atom in the molecule.

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The documentation for this struct was generated from the following file:

• src/gromacs/domdec/reversetopology.h